3-(2-methoxyethylamino)-1-(2-methylpropyl)-5,6,7,8-tetrahydroisoquinolin-2-ium-4-carbonitrile

Systemtic Name: 3-(2-methoxyethylamino)-1-(2-methylpropyl)-5,6,7,8-tetrahydroisoquinolin-2-ium-4-carbonitrile Openeye Name: 1-isobutyl-3-(2-methoxyethylamino)-5,6,7,8-tetrahydroisoquinolin-2-ium-4-carbonitrile CAS Name: 3-(2-methoxyethylamino)-1-(2-methylpropyl)-5,6,7,8-tetrahydroisoquinolin-2-ium-4-carbonitrile IUPAC Name: 3-(2-methoxyethylamino)-1-(2-methylpropyl)-5,6,7,8-tetrahydroisoquinolin-2-ium-4-carbonitrile Traditional Name: 1-isobutyl-3-(2-methoxyethylamino)-5,6,7,8-tetrahydroisoquinolin-2-ium-4-carbonitrile Formula: C17H26N3O+ MolecularWeight: 288.40784

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C2CCCCC2=C(C(=[NH+]1)NCCOC)C#N

Isomeric SMILES

CC(C)CC1=C2CCCCC2=C(C(=[NH+]1)NCCOC)C#N

InChI

InChI=1S/C17H25N3O/c1-12(2)10-16-14-7-5-4-6-13(14)15(11-18)17(20-16)19-8-9-21-3/h12H,4-10H2,1-3H3,(H,19,20)/p+1